PDB ligand accession: R88
DrugBank: DB08458
PubChem:
ChEMBL:
InChI Key: JAZMZJDLZUDIDG-NSCUHMNNSA-N
SMILES: CN(CC=CCOc1ccc(cc1)C(=O)c2ccc(cc2)Br)C3CC3
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: Benzophenones
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
1H36 | Download | Experimental | e1h36A1 e1h36A2 e1h36B1 e1h36B2 e1h36C1 e1h36C2 | Repetitive alpha hairpins Repetitive alpha hairpins Repetitive alpha hairpins Repetitive alpha hairpins Repetitive alpha hairpins Repetitive alpha hairpins | LigPlot |